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	hartrees
Energy at 0K	-196.418179
Energy at 298.15K
HF Energy	-196.418179
Nuclear repulsion energy	185.492129

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3028	3004	121.88
2	A	3013	2989	21.40
3	A	3011	2987	34.54
4	A	3008	2984	17.11
5	A	2998	2974	42.69
6	A	2982	2958	58.94
7	A	2967	2943	28.01
8	A	2965	2941	24.91
9	A	2957	2933	39.56
10	A	2951	2927	19.98
11	A	1514	1501	0.01
12	A	1489	1477	1.80
13	A	1488	1476	0.48
14	A	1484	1472	1.81
15	A	1479	1467	0.06
16	A	1327	1316	2.02
17	A	1327	1316	2.04
18	A	1319	1309	0.02
19	A	1300	1290	0.32
20	A	1282	1272	0.00
21	A	1259	1249	0.70
22	A	1216	1206	0.29
23	A	1200	1190	0.57
24	A	1183	1174	0.22
25	A	1149	1139	0.01
26	A	1019	1010	0.01
27	A	1011	1003	0.00
28	A	984	976	0.35
29	A	954	946	0.78
30	A	882	875	1.17
31	A	874	867	1.24
32	A	856	849	0.38
33	A	847	840	0.47
34	A	803	797	0.14
35	A	755	749	0.84
36	A	603	598	0.17
37	A	540	536	1.28
38	A	260	257	0.00
39	A	5i	4i	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	1.013	-0.767	0.255
C2	-0.338	1.259	0.126
C3	-1.319	0.037	0.015
C4	-0.412	-1.231	-0.154
C5	1.065	0.699	-0.242
H6	-0.324	1.639	1.163
H7	-0.637	2.104	-0.515
H8	-2.009	0.146	-0.838
H9	-1.949	-0.041	0.916
H10	-0.402	-1.550	-1.211
H11	-0.768	-2.091	0.435
H12	1.811	-1.402	-0.165
H13	1.121	-0.792	1.355
H14	1.206	0.713	-1.338
H15	1.891	1.283	0.199

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13	H14	H15
C1		2.4391	2.4784	1.5532	1.5492	2.8985	3.4004	3.3406	3.1204	2.1832	2.2271	1.1029	1.1058	2.1832	2.2311
C2	2.4391		1.5709	2.5068	1.5554	1.1038	1.1022	2.2270	2.2152	3.1122	3.3924	3.4332	2.8014	2.1973	2.2303
C3	2.4784	1.5709		1.5680	2.4877	2.2075	2.2400	1.1023	1.1025	2.2050	2.2385	3.4496	2.9046	2.9430	3.4478
C4	1.5532	2.5068	1.5680		2.4319	3.1586	3.3619	2.2166	2.2190	1.1042	1.1024	2.2296	2.1954	2.7922	3.4272
C5	1.5492	1.5554	2.4877	2.4319		2.1877	2.2245	3.1798	3.3125	2.8555	3.4072	2.2308	2.1858	1.1056	1.1029
H6	2.8985	1.1038	2.2075	3.1586	2.1877		1.7692	3.0115	2.3497	3.9763	3.8267	3.9457	2.8346	3.0746	2.4415
H7	3.4004	1.1022	2.2400	3.3619	2.2245	1.7692		2.4121	2.8928	3.7274	4.3039	4.2907	3.8703	2.4518	2.7524
H8	3.3406	2.2270	1.1023	2.2166	3.1798	3.0115	2.4121		1.7651	2.3657	2.8576	4.1762	3.9351	3.3023	4.1920
H9	3.1204	2.2152	1.1025	2.2190	3.3125	2.3497	2.8928	1.7651		3.0324	2.4148	4.1424	3.1905	3.9499	4.1241
H10	2.1832	3.1122	2.2050	1.1042	2.8555	3.9763	3.7274	2.3657	3.0324		1.7710	2.4528	3.0792	2.7792	3.9082
H11	2.2271	3.3924	2.2385	1.1024	3.4072	3.8267	4.3039	2.8576	2.4148	1.7710		2.7368	2.4708	3.8609	4.3030
H12	1.1029	3.4332	3.4496	2.2296	2.2308	3.9457	4.2907	4.1762	4.1424	2.4528	2.7368		1.7778	2.4928	2.7107
H13	1.1058	2.8014	2.9046	2.1954	2.1858	2.8346	3.8703	3.9351	3.1905	3.0792	2.4708	1.7778		3.0867	2.4975
H14	2.1832	2.1973	2.9430	2.7922	1.1056	3.0746	2.4518	3.3023	3.9499	2.7792	3.8609	2.4928	3.0867		1.7767
H15	2.2311	2.2303	3.4478	3.4272	1.1029	2.4415	2.7524	4.1920	4.1241	3.9082	4.3030	2.7107	2.4975	1.7767

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	C3	105.130	C1	C4	H10	109.317
C1	C4	H11	112.895	C1	C5	C2	103.561
C1	C5	H14	109.513	C1	C5	H15	113.478
C2	C3	C4	105.998	C2	C3	H8	111.636
C2	C3	H9	110.698	C2	C5	H14	110.179
C2	C5	H15	112.965	C3	C2	C5	105.448
C3	C2	H6	110.016	C3	C2	H7	112.675
C3	C4	H10	109.992	C3	C4	H11	112.751
C4	C1	C5	103.235	C4	C1	H12	113.064
C4	C1	H13	110.171	C4	C3	H8	111.017
C4	C3	H9	111.196	C5	C1	H12	113.454
C5	C1	H13	109.702	C5	C2	H6	109.537
C5	C2	H7	112.538	H6	C2	H7	106.640
H8	C3	H9	106.379	H10	C4	H11	106.753
H12	C1	H13	107.199	H14	C5	H15	107.129

All results from a given calculation for C₅H₁₀ (Cyclopentane)

using model chemistry: BLYP/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	C	-0.228
2	C	-0.231
3	C	-0.233
4	C	-0.230
5	C	-0.228
6	H	0.117
7	H	0.114
8	H	0.117
9	H	0.117
10	H	0.116
11	H	0.114
12	H	0.113
13	H	0.114
14	H	0.114
15	H	0.113

	x	y	z	Total
	-0.006	0.002	0.001	0.007
CHELPG
AIM
ESP

	x	y	z
x	7.914	0.003	0.000
y	0.003	7.921	0.004
z	0.000	0.004	7.165

<r²>	117.735
(<r²>)^1/2	10.851

All results from a given calculation for C5H10 (Cyclopentane)

using model chemistry: BLYP/6-31G*

States and conformations

All results from a given calculation for C₅H₁₀ (Cyclopentane)